SCHEMBL13314155

SCHEMBL13314155

CC(C)(C)OC(=O)NCCC(=O)NCC#Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1N

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLG P54098 1/20 0.41
▸ P2RY2 P41231 3/20 0.41
▸ P2RY4 P51582 3/20 0.41
▸ P2RY6 Q15077 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ EP300 Q09472 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17553295 0.99 POLB (0.42) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL13314154 0.89 POLG (0.47) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL6229367 0.88 POLG (0.46) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL12711700 0.88 DNMT1 (0.45) —
SCHEMBL6229380 0.88 POLG (0.46) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL19107433 0.87 POLB (0.47) POLB
SCHEMBL19107442 0.86 POLG (0.39) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL17833854 0.86 POLG (0.43) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL7661079 0.86 POLG (0.43) POLGP2RY2P2RY4P2RY6POLB
SCHEMBL12729532 0.86 POLG (0.43) POLGP2RY2P2RY4P2RY6POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10669538-B2 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2020-06-02 — — US disclosed
US-20170198283-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES NUEVOLUTION A/S (DK) 2017-07-13 — — US disclosed
US-20170198283-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES NUEVOLUTION A/S (DK) 2017-07-13 — — US disclosed
US-9688980-B2 Templated molecules and methods for using such molecules NUEVOLUTION (DK) 2017-06-27 — — US disclosed
US-9688980-B2 Templated molecules and methods for using such molecules NUEVOLUTION (DK) 2017-06-27 — — US disclosed
US-20150315567-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES NUEVOLUTION A/S (DK) 2015-11-05 — — US disclosed
US-20150315567-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES NUEVOLUTION A/S (DK) 2015-11-05 — — US disclosed
US-8932992-B2 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2015-01-13 — — US disclosed
US-8932992-B2 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2015-01-13 — — US disclosed
US-7727713-B2 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2010-06-01 — — US disclosed
US-7727713-B2 Templated molecules and methods for using such molecules NUEVOLUTION A/S (DK) 2010-06-01 — — US disclosed
US-20100016177-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES NUEVOLUTION A/S (DK) 2010-01-21 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100016177-A1 TEMPLATED MOLECULES AND METHODS FOR USING SUCH MOLECULES INTS6, ABL1, INMT POLG 245/4885P2RY2 4053/4885P2RY4 3614/4885
US-10669538-B2 Templated molecules and methods for using such molecules ABL1, DHFR, TYMS POLG 153/4885P2RY2 4597/4885P2RY4 4507/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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